#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d1h s ARG 3 N 0.00 3.38 0.00 0.00 3.00 -1.16 -4.39 118.95 119.77 1d1h s ARG 3 Ca 0.00 -0.87 0.00 0.00 0.00 0.00 0.00 55.73 54.86 1d1h s ARG 3 Cb 0.00 -4.71 0.00 0.00 0.00 0.00 0.00 34.95 30.24 1d1h s ARG 3 CO 0.00 -2.06 0.00 0.98 0.00 0.00 0.00 175.30 174.22 1d1h n TYR 4 N 8.51 -0.86 -1.67 -0.53 9.36 -1.26 -3.47 117.16 127.24 1d1h n TYR 4 Ca 0.15 0.00 -0.47 0.00 3.32 0.00 0.00 57.90 60.91 1d1h n TYR 4 Cb 0.49 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.16 1d1h n TYR 4 CO 0.00 0.00 0.00 -0.11 0.22 0.00 0.00 176.86 176.97 1d1h n LEU 5 N 0.00 3.13 -1.13 2.98 -0.00 -1.26 -1.19 117.00 119.53 1d1h n LEU 5 Ca 0.00 1.06 -0.11 0.00 -0.00 0.00 0.00 56.01 56.96 1d1h n LEU 5 Cb 0.00 -1.41 -0.02 0.00 -0.00 0.00 0.00 43.42 41.99 1d1h n LEU 5 CO 0.00 -0.26 -0.13 0.49 -0.00 0.00 0.00 177.39 177.49 1d1h n PHE 6 N 4.11 -0.36 -3.27 1.96 3.72 -0.74 -4.93 117.46 117.94 1d1h n PHE 6 Ca 0.18 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 57.13 1d1h n PHE 6 Cb 0.29 -2.42 -0.06 0.00 -0.94 0.00 0.00 39.48 36.35 1d1h n PHE 6 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1d1h s GLY 7 N -2.62 1.97 -0.29 1.37 0.00 -0.33 -4.74 107.32 102.68 1d1h s GLY 7 Ca 0.00 -2.24 -0.30 0.00 0.00 0.00 0.00 44.72 42.18 1d1h s GLY 7 CO 0.00 1.27 0.99 0.61 0.00 0.00 0.00 173.10 175.97 1d1h n GLY 8 N 5.23 0.10 3.17 0.20 0.00 -1.26 -3.56 105.19 109.06 1d1h n GLY 8 Ca -0.12 0.63 -0.21 0.00 0.00 0.00 0.00 46.02 46.32 1d1h n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d1h h LYS 10 N 4.94 0.00 0.00 0.00 1.63 -1.87 -3.43 116.57 117.83 1d1h h LYS 10 Ca -0.39 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.28 1d1h h LYS 10 Cb 1.17 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 32.78 1d1h h LYS 10 CO 0.44 0.19 0.01 -2.37 -3.45 0.00 0.00 179.45 174.27 1d1h n THR 11 N -2.86 0.00 0.14 1.00 5.66 -1.26 -5.03 114.28 111.93 1d1h n THR 11 Ca -0.04 -0.99 -0.01 0.00 -3.05 0.00 0.00 64.05 59.96 1d1h n THR 11 Cb 0.71 0.70 0.22 0.00 -1.55 0.00 0.00 70.33 70.41 1d1h n THR 11 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 1d1h h THR 12 N 1.67 1.38 -0.04 1.09 2.02 -1.93 -2.50 112.91 114.59 1d1h h THR 12 Ca -0.20 -1.81 0.00 0.00 0.77 0.00 0.00 66.41 65.17 1d1h h THR 12 Cb 0.80 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 69.17 1d1h h THR 12 CO 0.26 0.52 0.00 -1.20 0.37 0.00 0.00 175.52 175.47 1d1h n SER 13 N -3.91 0.28 -1.33 4.18 7.64 -1.26 -3.25 113.62 115.97 1d1h n SER 13 Ca -0.02 -1.79 0.12 0.00 1.01 0.00 0.00 58.87 58.20 1d1h n SER 13 Cb 0.54 -0.03 0.31 0.00 -1.01 0.00 0.00 64.21 64.02 1d1h n SER 13 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1d1h n ASP 14 N -0.45 3.89 -4.48 6.43 9.92 -0.94 -4.96 116.55 125.96 1d1h n ASP 14 Ca 0.07 -2.00 -0.23 0.00 -0.53 0.00 0.00 54.79 52.10 1d1h n ASP 14 Cb 0.07 -0.46 -0.11 0.00 -0.64 0.00 0.00 41.12 39.99 1d1h n ASP 14 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1d1h n LYS 17 N 0.00 0.00 0.06 0.00 4.76 -1.26 -4.42 118.16 117.30 1d1h n LYS 17 Ca 0.00 0.14 0.05 0.00 -2.87 0.00 0.00 58.31 55.62 1d1h n LYS 17 Cb 0.00 -0.54 0.23 0.00 -1.84 0.00 0.00 35.03 32.88 1d1h n LYS 17 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1d1h n HIS 18 N -1.92 0.27 -3.58 2.13 8.25 -1.26 -4.48 115.22 114.63 1d1h n HIS 18 Ca 0.00 0.14 -0.30 0.00 -0.26 0.00 0.00 57.72 57.30 1d1h n HIS 18 Cb 0.00 -0.72 -0.04 0.00 1.12 0.00 0.00 29.99 30.35 1d1h n HIS 18 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1d1h s LEU 19 N -3.55 4.20 -0.06 2.41 1.43 -1.26 0.24 118.68 122.09 1d1h s LEU 19 Ca -0.00 0.59 -0.03 0.00 -1.03 0.00 0.00 54.13 53.66 1d1h s LEU 19 Cb 0.03 -3.35 0.03 0.00 0.03 0.00 0.00 46.19 42.93 1d1h s LEU 19 CO 0.10 -0.04 0.13 -0.83 0.23 0.00 0.00 176.35 175.94 1d1h s GLY 20 N -2.81 -0.03 -0.31 -3.19 0.00 0.15 -4.57 107.32 96.56 1d1h s GLY 20 Ca 0.41 0.59 -0.29 0.00 0.00 0.00 0.00 44.72 45.44 1d1h s GLY 20 CO 0.27 0.84 1.14 0.00 0.00 0.00 0.00 173.10 175.35 1d1h n LYS 22 N 6.98 -0.49 -3.22 0.00 5.02 -1.26 -4.20 118.16 120.98 1d1h n LYS 22 Ca 0.13 -1.80 -0.40 0.00 -2.02 0.00 0.00 58.31 54.22 1d1h n LYS 22 Cb 0.47 -0.79 -0.07 0.00 -0.02 0.00 0.00 35.03 34.62 1d1h n LYS 22 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1d1h s PHE 23 N -2.78 3.32 0.00 2.13 2.19 -1.26 -4.28 117.98 117.31 1d1h s PHE 23 Ca 0.54 0.73 0.00 0.00 0.33 0.00 0.00 56.93 58.53 1d1h s PHE 23 Cb -0.02 -2.71 0.00 0.00 -1.31 0.00 0.00 43.02 38.98 1d1h s PHE 23 CO 0.37 -0.20 0.00 -2.13 1.83 0.00 0.00 175.22 175.09 1d1h n ARG 24 N 5.19 0.00 -0.27 10.12 0.00 -1.26 -4.80 116.66 125.63 1d1h n ARG 24 Ca -0.04 0.00 0.08 0.00 -0.00 0.00 0.00 57.85 57.89 1d1h n ARG 24 Cb 0.50 0.00 0.17 0.00 0.00 0.00 0.00 32.46 33.12 1d1h n ARG 24 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1d1h n ASP 25 N 1.94 -0.19 0.00 6.15 5.75 -1.26 -4.75 116.55 124.20 1d1h n ASP 25 Ca 0.00 1.31 0.00 0.00 -0.01 0.00 0.00 54.79 56.09 1d1h n ASP 25 Cb 0.00 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.65 1d1h n ASP 25 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 1d1h n LYS 26 N -5.17 0.00 -2.63 0.11 4.81 -1.26 -4.98 118.16 109.05 1d1h n LYS 26 Ca 0.15 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.48 1d1h n LYS 26 Cb 0.49 -0.33 -0.01 0.00 0.02 0.00 0.00 35.03 35.20 1d1h n LYS 26 CO 0.00 0.00 0.00 2.48 1.17 0.00 0.00 177.40 181.05 1d1h n TYR 27 N -1.01 -0.56 -4.27 5.64 0.18 -1.26 -1.82 117.16 114.05 1d1h n TYR 27 Ca 0.00 -0.92 -0.34 0.00 1.88 0.00 0.00 57.90 58.52 1d1h n TYR 27 Cb 0.00 -0.16 -0.11 0.00 -0.38 0.00 0.00 39.34 38.69 1d1h n TYR 27 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1d1h s ALA 29 N 0.36 1.26 0.22 0.00 0.00 -0.95 -1.79 121.76 120.87 1d1h s ALA 29 Ca -0.02 -0.81 -0.21 0.00 0.00 0.00 0.00 51.96 50.92 1d1h s ALA 29 Cb -0.14 -0.23 -0.13 0.00 0.00 0.00 0.00 23.12 22.62 1d1h s ALA 29 CO 0.02 0.26 0.30 0.91 0.00 0.00 0.00 175.76 177.25 1d1h n TRP 30 N 2.08 -0.84 0.00 0.00 5.03 -1.26 0.33 117.44 122.78 1d1h n TRP 30 Ca -0.17 0.68 0.00 0.00 3.03 0.00 0.00 57.50 61.04 1d1h n TRP 30 Cb 0.55 -1.53 0.00 0.00 -1.03 0.00 0.00 31.31 29.30 1d1h n TRP 30 CO 0.00 0.00 0.00 -0.25 -0.03 0.00 0.00 177.69 177.41 1d1h n ASP 31 N 1.70 0.00 -3.51 -0.99 8.00 0.67 -4.44 116.55 117.97 1d1h n ASP 31 Ca 0.13 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.43 1d1h n ASP 31 Cb 0.24 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.21 1d1h n ASP 31 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1d1h s PHE 32 N 0.00 -0.18 0.39 1.24 5.36 -1.24 -3.17 117.98 120.37 1d1h s PHE 32 Ca 0.00 0.08 0.08 0.00 -0.96 0.00 0.00 56.93 56.13 1d1h s PHE 32 Cb 0.00 -0.44 -0.03 0.00 -0.34 0.00 0.00 43.02 42.21 1d1h s PHE 32 CO 0.00 -0.60 0.31 0.95 -1.46 0.00 0.00 175.22 174.42 1d1h s THR 33 N 2.29 2.88 -0.33 0.12 -4.23 -1.26 -5.02 115.64 110.09 1d1h s THR 33 Ca 0.06 -1.42 0.07 0.00 -1.18 0.00 0.00 61.69 59.22 1d1h s THR 33 Cb -0.16 -3.04 0.46 0.00 1.34 0.00 0.00 72.50 71.10 1d1h s THR 33 CO -0.13 -0.06 1.34 0.33 -0.54 0.00 0.00 174.62 175.55 1d1h n PHE 34 N -1.43 2.24 -1.45 3.99 -0.00 -1.26 -5.19 117.46 114.35 1d1h n PHE 34 Ca 0.01 -2.15 0.00 0.00 -0.00 0.00 0.00 57.45 55.31 1d1h n PHE 34 Cb 0.61 -0.49 0.00 0.00 -0.00 0.00 0.00 39.48 39.61 1d1h n PHE 34 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21